The number-adaptive multiscale QM/MM molecular dynamics...

Chemical Physics Letters 2012 Vol. 524; Iss. none

The number-adaptive multiscale QM/MM molecular dynamics simulation: Application to liquid water

Norio Takenaka, Yukichi Kitamura, Yoshiyuki Koyano, Masataka Nagaoka
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Volume:
524
Year:
2012
Language:
english
Pages:
6
DOI:
10.1016/j.cplett.2011.12.053
File:
PDF, 1.25 MB
english, 2012
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